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8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate
In the title hydrate, C(19)H(15)N(3)O(3)·H(2)O, the three aromatic groups in the quinoline derivative are close to coplanar: the central oxadiazole fragment makes dihedral angles of 15.7 (2)° with the benzene ring and 5.30 (14)° with the quinoline ring system. In the crystal, the organic molecules...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2013
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648286/ https://www.ncbi.nlm.nih.gov/pubmed/23723906 http://dx.doi.org/10.1107/S1600536813010271 |
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author | Shen, Hong Bai, Shu-Yuan Han, Xin-Yi Li, Xiang-Zhi Wang, Hai-Bo |
author_facet | Shen, Hong Bai, Shu-Yuan Han, Xin-Yi Li, Xiang-Zhi Wang, Hai-Bo |
author_sort | Shen, Hong |
collection | PubMed |
description | In the title hydrate, C(19)H(15)N(3)O(3)·H(2)O, the three aromatic groups in the quinoline derivative are close to coplanar: the central oxadiazole fragment makes dihedral angles of 15.7 (2)° with the benzene ring and 5.30 (14)° with the quinoline ring system. In the crystal, the organic molecules are connected with water molecules by pairs of O—H⋯N hydrogen bonds involving the quinoline and oxadiazole N atoms. The molecules form stacks along the a axis, neighboring molecules within each stack being related by inversion and the shortest distance between the centroids of the oxadiazole and pyridine rings being 3.500 (2) Å. Molecules from neighboring stacks are linked by weak C—H⋯O hydrogen bonds, forming a three-dimensional structure. |
format | Online Article Text |
id | pubmed-3648286 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2013 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-36482862013-05-30 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate Shen, Hong Bai, Shu-Yuan Han, Xin-Yi Li, Xiang-Zhi Wang, Hai-Bo Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title hydrate, C(19)H(15)N(3)O(3)·H(2)O, the three aromatic groups in the quinoline derivative are close to coplanar: the central oxadiazole fragment makes dihedral angles of 15.7 (2)° with the benzene ring and 5.30 (14)° with the quinoline ring system. In the crystal, the organic molecules are connected with water molecules by pairs of O—H⋯N hydrogen bonds involving the quinoline and oxadiazole N atoms. The molecules form stacks along the a axis, neighboring molecules within each stack being related by inversion and the shortest distance between the centroids of the oxadiazole and pyridine rings being 3.500 (2) Å. Molecules from neighboring stacks are linked by weak C—H⋯O hydrogen bonds, forming a three-dimensional structure. International Union of Crystallography 2013-04-20 /pmc/articles/PMC3648286/ /pubmed/23723906 http://dx.doi.org/10.1107/S1600536813010271 Text en © Shen et al. 2013 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Organic Papers Shen, Hong Bai, Shu-Yuan Han, Xin-Yi Li, Xiang-Zhi Wang, Hai-Bo 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title | 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title_full | 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title_fullStr | 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title_full_unstemmed | 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title_short | 8-{[3-(3-Methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
title_sort | 8-{[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methoxy}quinoline monohydrate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3648286/ https://www.ncbi.nlm.nih.gov/pubmed/23723906 http://dx.doi.org/10.1107/S1600536813010271 |
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